ChemSpider 2D Image | (3beta,5xi)-3,24-Dihydroxy-11,15,23-trioxolanost-8-en-26-oic acid | C30H44O7

(3β,5ξ)-3,24-Dihydroxy-11,15,23-trioxolanost-8-en-26-oic acid

  • Molecular FormulaC30H44O7
  • Average mass516.666 Da
  • Monoisotopic mass516.308716 Da
  • ChemSpider ID78445653

  • defined stereocentres - 6 of 9 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3β,5ξ)-3,24-Dihydroxy-11,15,23-trioxolanost-8-en-26-oic acid [ACD/IUPAC Name]
(3β,5ξ)-3,24-Dihydroxy-11,15,23-trioxolanost-8-en-26-säure [German] [ACD/IUPAC Name]
Acide (3β,5ξ)-3,24-dihydroxy-11,15,23-trioxolanost-8-én-26-oïque [French] [ACD/IUPAC Name]
Lanost-8-en-26-oic acid, 3,24-dihydroxy-11,15,23-trioxo-, (3β,5ξ)- [ACD/Index Name]
Resinacein S

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 678.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 113.9±6.0 kJ/mol
Flash Point: 378.0±28.0 °C
Index of Refraction: 1.565
Molar Refractivity: 137.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.04
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 9.80
ACD/KOC (pH 5.5): 79.47
ACD/LogD (pH 7.4): 0.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.30
Polar Surface Area: 129 Å2
Polarizability: 54.4±0.5 10-24cm3
Surface Tension: 53.2±5.0 dyne/cm
Molar Volume: 421.5±5.0 cm3

Click to predict properties on the Chemicalize site


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